4-bromanyl-N-[4-(7-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[4-(7-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide Openeye Name: 4-bromo-N-[4-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide CAS Name: 4-bromo-N-[4-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[4-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide Traditional Name: 4-bromo-N-[4-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide Formula: C21H16BrFN2O2S MolecularWeight: 459.331343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=C1C=CC(=C2)F)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN=C(C2=C1C=CC(=C2)F)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrFN2O2S/c22-16-4-9-19(10-5-16)28(26,27)25-18-7-2-15(3-8-18)21-20-13-17(23)6-1-14(20)11-12-24-21/h1-10,13,25H,11-12H2